Using VASP

Moderators: Global Moderator, Moderator

New Topic

5338 topics

Page 203 of 267
- Jump to page:
Previous
1
…
201
202
203
204
205
…
267
Next

Topics

Replies

Views

Last post

electric field and the total system energy

Last post by tholme « Tue Jun 08, 2010 1:31 am
Replies: 1
by tholme » Mon May 17, 2010 7:58 pm

1 Replies

2120 Views

Last post by tholme
Tue Jun 08, 2010 1:31 am
How do I calculate the atomic orbital energy using Vasp?

Last post by panda « Mon Jun 07, 2010 4:37 pm
Replies: 4
by zzhlax » Wed Jun 02, 2010 1:16 am

4 Replies

2437 Views

Last post by panda
Mon Jun 07, 2010 4:37 pm
nupdown

Last post by cpopa « Fri Jun 04, 2010 11:28 am
Replies: 2
by cpopa » Thu Jun 03, 2010 9:35 am

2 Replies

2601 Views

Last post by cpopa
Fri Jun 04, 2010 11:28 am
Phonon density of states

Last post by forsdan « Fri Jun 04, 2010 7:55 am
Replies: 10
by Danny » Wed Apr 14, 2010 1:43 pm

10 Replies

9445 Views

Last post by forsdan
Fri Jun 04, 2010 7:55 am
How to incorporate Atomic Site Occupancy ?

Last post by forsdan « Thu Jun 03, 2010 6:11 pm
Replies: 1
by Phani Kanth » Thu Jun 03, 2010 10:15 am

1 Replies

2114 Views

Last post by forsdan
Thu Jun 03, 2010 6:11 pm
why does the density of states look so spiky?

Last post by riche « Tue Jun 01, 2010 4:49 pm
Replies: 3
by riche » Fri May 28, 2010 11:15 am

3 Replies

3908 Views

Last post by riche
Tue Jun 01, 2010 4:49 pm
About the GW computation

Last post by panda « Mon May 31, 2010 6:27 pm
Replies: 1
by VASP001 » Fri May 28, 2010 8:09 am

1 Replies

4547 Views

Last post by panda
Mon May 31, 2010 6:27 pm
Change Binary files to ASCII

Last post by admin « Fri May 28, 2010 3:16 pm
Replies: 6
by mamini » Tue May 18, 2010 1:48 pm

6 Replies

4189 Views

Last post by admin
Fri May 28, 2010 3:16 pm
how to extract the bands of surface states from the band structure plot?

Last post by forsdan « Fri May 28, 2010 12:49 pm
Replies: 6
by zzhlax » Mon May 24, 2010 3:09 pm

6 Replies

4283 Views

Last post by forsdan
Fri May 28, 2010 12:49 pm
Different results in DOSCAR file when NUPDOWN flag is used

Last post by ledssiul « Thu May 27, 2010 7:08 pm
Replies: 2
by ledssiul » Wed May 26, 2010 9:04 am

2 Replies

2443 Views

Last post by ledssiul
Thu May 27, 2010 7:08 pm
Hydrogen termination of Si(100)

Last post by Danny « Thu May 27, 2010 8:01 am
Replies: 5
by supreme_general » Wed May 26, 2010 8:02 am

5 Replies

3658 Views

Last post by Danny
Thu May 27, 2010 8:01 am
problem in HSE calculation!

Last post by fzcsydl « Wed May 26, 2010 10:59 pm
Replies: 2
by fzcsydl » Tue May 25, 2010 11:00 pm

2 Replies

2326 Views

Last post by fzcsydl
Wed May 26, 2010 10:59 pm
Surface Si(111) Hydrogen terminated + Molecule

Last post by Oscar_rp « Wed May 26, 2010 7:44 pm
Replies: 2
by Oscar_rp » Wed May 26, 2010 9:09 am

2 Replies

1934 Views

Last post by Oscar_rp
Wed May 26, 2010 7:44 pm
negative fermi energy- surface calculations

Last post by forsdan « Wed May 26, 2010 5:22 pm
Replies: 5
by kamala » Fri May 21, 2010 7:45 am

5 Replies

3905 Views

Last post by forsdan
Wed May 26, 2010 5:22 pm
Problems with GaAs bandgap with HSE hybrid functional (VASP 5.2)

Last post by dhfphysics « Wed May 26, 2010 3:20 am
Replies: 1
by Eugene » Mon Jul 27, 2009 7:44 pm

1 Replies

5236 Views

Last post by dhfphysics
Wed May 26, 2010 3:20 am
Magnetic anisotropy energy of bulk Cobalt

Last post by vasp16888 « Tue May 25, 2010 9:24 pm
Replies: 3
by prasen » Mon Mar 15, 2010 6:08 am

3 Replies

4108 Views

Last post by vasp16888
Tue May 25, 2010 9:24 pm
About the calculation of magnetic anistropies energy

Last post by vasp16888 « Tue May 25, 2010 6:32 pm
Replies: 5
by okuno » Fri Oct 17, 2008 1:35 pm

5 Replies

7297 Views

Last post by vasp16888
Tue May 25, 2010 6:32 pm
ISOTOPE CALCULATION

Last post by forsdan « Mon May 24, 2010 2:48 pm
Replies: 1
by Maximus » Mon May 24, 2010 7:33 am

1 Replies

3469 Views

Last post by forsdan
Mon May 24, 2010 2:48 pm
Fermi energy

Last post by phuongvlpt « Sun May 23, 2010 3:42 pm
Replies: 6
by phuongvlpt » Fri May 07, 2010 8:31 am

6 Replies

2584 Views

Last post by phuongvlpt
Sun May 23, 2010 3:42 pm
K-Point Convergence for Surface Slab.

Last post by alex « Sat May 22, 2010 9:42 am
Replies: 1
by Sharani » Fri May 21, 2010 4:02 pm

1 Replies

2356 Views

Last post by alex
Sat May 22, 2010 9:42 am

New Topic

5338 topics

Page 203 of 267
- Jump to page:
Previous
1
…
201
202
203
204
205
…
267
Next

Return to Board Index

Forum permissions

You cannot post new topics in this forum
You cannot reply to topics in this forum
You cannot edit your posts in this forum
You cannot delete your posts in this forum
You cannot post attachments in this forum